4-Bromomethyl-1,1-difluoro-cyclohexane


Chemical Name: 4-Bromomethyl-1,1-difluoro-cyclohexane
CAS Number: 858121-94-5
Product Number: AG008GG0(AGN-PC-09R4JI)
Synonyms:
MDL No: MFCD11847776
Molecular Formula: C7H11BrF2
Molecular Weight: 213.0630

Identification/Properties


Computed Properties
Molecular Weight:
213.066g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
212.001g/mol
Monoisotopic Mass:
212.001g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
104
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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